Creatinine-(methyl-<sup>13</sup>C)


Chemical Name: Creatinine-(methyl-<sup>13</sup>C)
CAS Number: 1173022-95-1
Product Number: AG009MP2(AGN-PC-0WAGGY)
Synonyms:
MDL No:
Molecular Formula: C4H7N3O
Molecular Weight: 114.110534838

Identification/Properties


Computed Properties
Molecular Weight:
114.112g/mol
XLogP3:
-1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
114.062g/mol
Monoisotopic Mass:
114.062g/mol
Topological Polar Surface Area:
58.7A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
151
Isotope Atom Count:
1
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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